5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide

C119H102FN15O17S5 — CID 158914086

IUPAC5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide
SMILESC#CC(NC(=O)c1cc(F)ccc1NS(=O)(=O)c1cccc2cccnc12)c1ccccc1.C#CC(NC(=O)c1cc(OC)ccc1NS(=O)(=O)c1cccc2cccnc12)c1ccccc1.C#CC(NC(=O)c1ccccc1NS(=O)(=O)c1cccc2cccnc12)c1ccccc1.CC[C@H](NC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccccn1)c1ccccc1.CC[C@H](NC(=O)c1ccccc1NS(=O)(=O)c1ccccn1)c1ccccc1
InChIInChI=1S/C26H21N3O4S.C25H18FN3O3S.C25H19N3O3S.C22H23N3O4S.C21H21N3O3S/c1-3-22(18-9-5-4-6-10-18)28-26(30)21-17-20(33-2)14-15-23(21)29-34(31,32)24-13-7-11-19-12-8-16-27-25(19)24;1-2-21(17-8-4-3-5-9-17)28-25(30)20-16-19(26)13-14-22(20)29-33(31,32)23-12-6-10-18-11-7-15-27-24(18)23;1-2-21(18-10-4-3-5-11-18)27-25(29)20-14-6-7-15-22(20)28-32(30,31)23-16-8-12-19-13-9-17-26-24(19)23;1-3-19(16-9-5-4-6-10-16)24-22(26)18-15-17(29-2)12-13-20(18)25-30(27,28)21-11-7-8-14-23-21;1-2-18(16-10-4-3-5-11-16)23-21(25)17-12-6-7-13-19(17)24-28(26,27)20-14-8-9-15-22-20/h1,4-17,22,29H,2H3,(H,28,30);1,3-16,21,29H,(H,28,30);1,3-17,21,28H,(H,27,29);4-15,19,25H,3H2,1-2H3,(H,24,26);3-15,18,24H,2H2,1H3,(H,23,25)/t;;;19-;18-/m...00/s1
InChIKeyJGZWCWPWVFFXBE-VVOXADMPSA-N
MW2193.55 g/mol
LogP20.10
Rot. Bonds34

About 5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide

5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide (PubChem CID 158914086) has the molecular formula C119H102FN15O17S5 and a molecular weight of 2193.55 g/mol. Its IUPAC name is 5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide.

Molecular Properties

Compound Name5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide
PubChem CID158914086
Molecular FormulaC119H102FN15O17S5
Molecular Weight2193.55 g/mol
Exact Mass2191.62
IUPAC Name5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide
SMILESC#CC(NC(=O)c1cc(F)ccc1NS(=O)(=O)c1cccc2cccnc12)c1ccccc1.C#CC(NC(=O)c1cc(OC)ccc1NS(=O)(=O)c1cccc2cccnc12)c1ccccc1.C#CC(NC(=O)c1ccccc1NS(=O)(=O)c1cccc2cccnc12)c1ccccc1.CC[C@H](NC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccccn1)c1ccccc1.CC[C@H](NC(=O)c1ccccc1NS(=O)(=O)c1ccccn1)c1ccccc1
InChIInChI=1S/C26H21N3O4S.C25H18FN3O3S.C25H19N3O3S.C22H23N3O4S.C21H21N3O3S/c1-3-22(18-9-5-4-6-10-18)28-26(30)21-17-20(33-2)14-15-23(21)29-34(31,32)24-13-7-11-19-12-8-16-27-25(19)24;1-2-21(17-8-4-3-5-9-17)28-25(30)20-16-19(26)13-14-22(20)29-33(31,32)23-12-6-10-18-11-7-15-27-24(18)23;1-2-21(18-10-4-3-5-11-18)27-25(29)20-14-6-7-15-22(20)28-32(30,31)23-16-8-12-19-13-9-17-26-24(19)23;1-3-19(16-9-5-4-6-10-16)24-22(26)18-15-17(29-2)12-13-20(18)25-30(27,28)21-11-7-8-14-23-21;1-2-18(16-10-4-3-5-11-16)23-21(25)17-12-6-7-13-19(17)24-28(26,27)20-14-8-9-15-22-20/h1,4-17,22,29H,2H3,(H,28,30);1,3-16,21,29H,(H,28,30);1,3-17,21,28H,(H,27,29);4-15,19,25H,3H2,1-2H3,(H,24,26);3-15,18,24H,2H2,1H3,(H,23,25)/t;;;19-;18-/m...00/s1
InChIKeyJGZWCWPWVFFXBE-VVOXADMPSA-N
XLogP20.10
TPSA459.26 Ų
H-Bond Donors10
H-Bond Acceptors22
Rotatable Bonds34
Heavy Atoms157
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002193.55
LogP ≤ 520.10
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide with MolForge

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Related Compounds

5-methoxy-N-[(1S)-1-phenylpropyl]-2-(quinolin-8-ylsulfonylamino)benzamide;molecular hydrogen
CID 159626973
N-[1-(4-methylphenyl)propyl]-2-(quinolin-8-ylsulfonylamino)benzamide
CID 20796159
5-fluoro-N-[1-[2-(2-iminoethyl)phenyl]propyl]-2-(quinolin-8-ylsulfonylamino)benzamide
CID 163644939
sodium [4-fluoro-2-[[(1S)-1-phenylpropyl]carbamoyl]phenyl]-quinolin-8-ylsulfonylazanide
CID 24852044
5-fluoro-2-(quinolin-8-ylsulfonylamino)benzoic acid
CID 22398672
5-methoxy-N-[(1S)-1-phenylpropyl]-2-(propylsulfonylamino)benzamide
CID 58892109
N-[(2-cyclopropylphenyl)methyl]-5-fluoro-2-(quinolin-8-ylsulfonylamino)benzamide
CID 22398726
N-(2,5-difluorophenyl)quinoline-8-sulfonamide
CID 22773481
2-[(2,5-dimethoxyphenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 51557476
5-methoxy-2-[(4-methylphenyl)sulfonylamino]-N-[1-(6-methyl-3-pyridinyl)propyl]benzamide
CID 58892006
N-(2,3-dimethoxyphenyl)quinoline-8-sulfonamide
CID 3866922
3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide
CID 92675789

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide?
The IUPAC name of 5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide (CID 158914086) is 5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide.
What is the SMILES notation for 5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide?
The canonical SMILES for 5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide is C#CC(NC(=O)c1cc(F)ccc1NS(=O)(=O)c1cccc2cccnc12)c1ccccc1.C#CC(NC(=O)c1cc(OC)ccc1NS(=O)(=O)c1cccc2cccnc12)c1ccccc1.C#CC(NC(=O)c1ccccc1NS(=O)(=O)c1cccc2cccnc12)c1ccccc1.CC[C@H](NC(=O)c1cc(OC)ccc1NS(=O)(=O)c1ccccn1)c1ccccc1.CC[C@H](NC(=O)c1ccccc1NS(=O)(=O)c1ccccn1)c1ccccc1.
What is the InChIKey of 5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide?
The InChIKey is JGZWCWPWVFFXBE-VVOXADMPSA-N. The full InChI is InChI=1S/C26H21N3O4S.C25H18FN3O3S.C25H19N3O3S.C22H23N3O4S.C21H21N3O3S/c1-3-22(18-9-5-4-6-10-18)28-26(30)21-17-20(33-2)14-15-23(21)29-34(31,32)24-13-7-11-19-12-8-16-27-25(19)24;1-2-21(17-8-4-3-5-9-17)28-25(30)20-16-19(26)13-14-22(20)29-33(31,32)23-12-6-10-18-11-7-15-27-24(18)23;1-2-21(18-10-4-3-5-11-18)27-25(29)20-14-6-7-15-22(20)28-32(30,31)23-16-8-12-19-13-9-17-26-24(19)23;1-3-19(16-9-5-4-6-10-16)24-22(26)18-15-17(29-2)12-13-20(18)25-30(27,28)21-11-7-8-14-23-21;1-2-18(16-10-4-3-5-11-16)23-21(25)17-12-6-7-13-19(17)24-28(26,27)20-14-8-9-15-22-20/h1,4-17,22,29H,2H3,(H,28,30);1,3-16,21,29H,(H,28,30);1,3-17,21,28H,(H,27,29);4-15,19,25H,3H2,1-2H3,(H,24,26);3-15,18,24H,2H2,1H3,(H,23,25)/t;;;19-;18-/m...00/s1.
What are the key properties of 5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide?
5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide has a molecular weight of 2193.55 g/mol, XLogP of 20.10, 34 rotatable bonds, 10 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;5-methoxy-N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;5-methoxy-N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide;N-[(1S)-1-phenylpropyl]-2-(pyridin-2-ylsulfonylamino)benzamide;N-(1-phenylprop-2-ynyl)-2-(quinolin-8-ylsulfonylamino)benzamide is sourced from PubChem (CID 158914086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).